SCHEMBL4280169

SCHEMBL4280169

Oc1cccc(-c2ccc[c]c2OCc2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 8/20 0.43
PTGER4 P35408 6/20 0.42
PTGER3 P43115 6/20 0.42
PTGER2 P43116 5/20 0.42
MCL1 Q07820 1/20 0.40
CYP2C9 P11712 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTGS2 P35354 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HIF1A Q16665 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADORA1 P30542 1/20 0.38
HSD17B1 P14061 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7466776 0.87 GSTP1 (0.42) PTGER1PTGER4PTGER3PTGER2SMN1; SMN2
SCHEMBL4288181 0.83 HSD17B1 (0.38) CYP2C9HSD17B1HSD17B2
SCHEMBL4282286 0.80 MAOB (0.44) PTGER1PTGER4PTGER3PTGER2
SCHEMBL4279106 0.80 HSD17B1 (0.39) CYP2C9CYP1A2CYP2C19ADORA1HSD17B1
SCHEMBL4275974 0.80 HSD17B1 (0.36) CYP2C9HSD17B1HSD17B2
SCHEMBL4276950 0.80 HSD17B1 (0.38) CYP2C9HSD17B1HSD17B2
SCHEMBL7471019 0.80 MAOB (0.47) PTGER1SMN1; SMN2RAB9AMAPTNPSR1
SCHEMBL7470974 0.80 PLA2G1B (0.44) PTGER1CYP2C9KDM4E
SCHEMBL7460118 0.80 MAOB (0.43) LMNAPTGS1PTGS2
SCHEMBL4288061 0.78 CHRM3 (0.38) CYP2C9HSD17B1HSD17B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2397462-A2 Compounds, compositions and methods of treatment for heart failure Cytokinetics, Inc. (US) 2011-12-21 EP disclosed
US-20090176307-A1 Compounds, Compositions and Methods CYTOKINETICS, INC. 2009-07-09 US disclosed
US-7491826-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2009-02-17 US disclosed
US-7399866-B2 Compounds, compositions, and methods CYTOKINETICS, INC. (US) 2008-07-15 US disclosed
US-20060241110-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2006-10-26 US disclosed
US-20050159416-A1 Compounds, compositions and methods CYTOKINETICS, INCORPORATED 2005-07-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060241110-A1 Compounds, compositions, and methods TNNI3, TNNT2, TNNC1 PTGER1 3447/4885PTGER4 3707/4885PTGER3 3255/4885
US-20050159416-A1 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 PTGER1 3459/4885PTGER4 3696/4885PTGER3 3218/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.